1-[2-(4-fluorophenyl)ethyl]-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]thiourea

Systemtic Name: 1-[2-(4-fluorophenyl)ethyl]-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]thiourea Openeye Name: 1-[2-(4-fluorophenyl)ethyl]-3-[(4-hydroxy-3-methoxy-phenyl)methyl]thiourea CAS Name: 1-[2-(4-fluorophenyl)ethyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[2-(4-fluorophenyl)ethyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]thiourea Traditional Name: 1-[2-(4-fluorophenyl)ethyl]-3-vanillyl-thiourea Formula: C17H19FN2O2S MolecularWeight: 334.408363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=S)NCCC2=CC=C(C=C2)F)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=S)NCCC2=CC=C(C=C2)F)O

InChI

InChI=1S/C17H19FN2O2S/c1-22-16-10-13(4-7-15(16)21)11-20-17(23)19-9-8-12-2-5-14(18)6-3-12/h2-7,10,21H,8-9,11H2,1H3,(H2,19,20,23)